SCHEMBL29528474

SCHEMBL29528474

Cn1c(-c2ccc(-c3cc(-c4ccccc4)c(-c4ccccc4)c(-c4ccc(-c5nc6ccccc6n5C)cc4)c3)cc2)nc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
KDM4E B2RXH2 7/20 0.58
PKM P14618 3/20 0.58
RAB9A P51151 3/20 0.58
TP53 P04637 3/20 0.58
HSD17B10 Q99714 3/20 0.58
GAA P10253 3/20 0.58
NPC1 O15118 2/20 0.58
ALOX15 P16050 2/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 4/20 0.56
MAPT P10636 2/20 0.56
LMNA P02545 1/20 0.56
HTT P42858 1/20 0.56
GFER P55789 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29528918 0.89 MEN1 (0.50) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL29528393 0.89 ALDH1A1 (0.61) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL29528150 0.88 MEN1 (0.51) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL9611665 0.87 ALDH1A1 (0.75) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL29528292 0.85 ALDH1A1 (0.65) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL19310495 0.84 ALDH1A1 (0.63) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL29528769 0.84 ALDH1A1 (0.63) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL25861584 0.84 ALDH1A1 (0.50) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL517706 0.83 MEN1 (0.77) ALDH1A1KDM4EPKMRAB9ATP53
SCHEMBL29528519 0.83 ALDH1A1 (0.46) ALDH1A1KDM4EPKMRAB9ATP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11283027-B1 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2022-03-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11283027-B1 Composition of matter for use in organic light-emitting diodes ALDH1A2, CYBA, CRY2 ALDH1A1 45/4885KDM4E 4331/4885PKM 893/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.